Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ix9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N GLN 1.A OE1 no hydrogen 2.893 N/A ARG 3.A N ASP 71.A OD2 no hydrogen 3.025 N/A ARG 3.A NH1 PRO 69.A O no hydrogen 2.917 N/A ILE 4.A N ASP 26.A O no hydrogen 2.817 N/A GLY 5.A N TRP 72.A O no hydrogen 2.861 N/A VAL 6.A N HIS 28.A O no hydrogen 2.759 N/A ILE 7.A N LEU 74.A O no hydrogen 2.736 N/A THR 9.A OG1 LEU 30.A O no hydrogen 2.833 N/A GLY 14.A N GLY 10.A O no hydrogen 2.797 N/A PHE 15.A N ALA 11.A O no hydrogen 3.042 N/A TYR 16.A N ILE 12.A O no hydrogen 3.012 N/A TYR 16.A OH GLY 145.A O no hydrogen 2.953 N/A GLY 17.A N GLY 13.A O no hydrogen 2.948 N/A LEU 18.A N GLY 14.A O no hydrogen 2.803 N/A MET 19.A N PHE 15.A O no hydrogen 2.946 N/A LEU 20.A N TYR 16.A O no hydrogen 3.089 N/A ALA 21.A N GLY 17.A O no hydrogen 2.841 N/A HIS 22.A N LEU 18.A O no hydrogen 2.815 N/A ALA 23.A N MET 19.A O no hydrogen 3.166 N/A ALA 23.A N LEU 20.A O no hydrogen 3.122 N/A GLY 24.A N ALA 21.A O no hydrogen 3.138 N/A HIS 25.A N LEU 20.A O no hydrogen 3.164 N/A HIS 25.A ND1 LEU 20.A O no hydrogen 2.878 N/A HIS 25.A NE2 GLU 174.A OE2 no hydrogen 2.561 N/A HIS 28.A N ILE 4.A O no hydrogen 2.815 N/A HIS 28.A ND1 TYR 61.A OH no hydrogen 2.638 N/A HIS 28.A NE2 ASP 26.A OD2 no hydrogen 2.818 N/A PHE 29.A N GLN 59.A O no hydrogen 2.813 N/A LEU 30.A N VAL 6.A O no hydrogen 2.804 N/A LEU 31.A N TYR 61.A O no hydrogen 2.849 N/A PHE 35.A N ARG 32.A O no hydrogen 3.147 N/A VAL 38.A N GLU 34.A O no hydrogen 3.049 N/A ASN 39.A N PHE 35.A O no hydrogen 2.632 N/A ARG 40.A N GLU 36.A O no hydrogen 3.216 N/A ALA 41.A N ALA 37.A O no hydrogen 2.894 N/A GLY 42.A N VAL 38.A O no hydrogen 2.859 N/A LEU 43.A N LEU 55.A O no hydrogen 2.900 N/A SER 44.A N GLY 137.A O no hydrogen 2.856 N/A SER 44.A OG GLY 137.A O no hydrogen 3.196 N/A LEU 45.A N ARG 53.A O no hydrogen 2.682 N/A ASN 46.A N ILE 139.A O no hydrogen 2.861 N/A ASN 46.A ND2 GLU 140.A OE1 no hydrogen 3.396 N/A SER 47.A N GLY 51.A O no hydrogen 3.049 N/A SER 47.A OG HIS 141.A ND1 no hydrogen 2.654 N/A ALA 48.A N HIS 141.A O no hydrogen 2.907 N/A VAL 49.A N SER 47.A OG no hydrogen 2.994 N/A HIS 50.A N SER 47.A OG no hydrogen 2.869 N/A GLY 51.A N SER 47.A O no hydrogen 2.814 N/A ARG 53.A N LEU 45.A O no hydrogen 2.923 N/A LEU 55.A N LEU 43.A O no hydrogen 2.746 N/A GLN 59.A NE2 ASP 26.A OD1 no hydrogen 2.969 N/A GLN 59.A NE2 VAL 27.A O no hydrogen 2.797 N/A TYR 61.A N PHE 29.A O no hydrogen 2.834 N/A TYR 61.A OH HIS 28.A ND1 no hydrogen 2.638 N/A ASP 66.A N SER 63.A O no hydrogen 3.119 N/A MET 67.A N ALA 64.A O no hydrogen 3.150 N/A CYS 70.A N ALA 92.A O no hydrogen 2.926 N/A CYS 70.A SG PRO 68.A O no hydrogen 3.278 N/A ASP 71.A N ARG 3.A O no hydrogen 2.775 N/A TRP 72.A N ARG 3.A O no hydrogen 3.243 N/A TRP 72.A NE1 GLU 167.A OE2 no hydrogen 2.972 N/A LEU 73.A N LYS 98.A O no hydrogen 2.758 N/A LEU 74.A N GLY 5.A O no hydrogen 2.647 N/A VAL 75.A N LEU 100.A O no hydrogen 2.879 N/A GLY 76.A N ILE 7.A O no hydrogen 2.913 N/A LYS 78.A NZ ASP 266.A OD1 no hydrogen 2.818 N/A LYS 78.A NZ ASP 266.A OD2 no hydrogen 3.174 N/A THR 79.A N GLU 274.A OE1 no hydrogen 2.924 N/A THR 79.A OG1 GLU 274.A OE1 no hydrogen 2.829 N/A ASN 82.A N THR 79.A O no hydrogen 3.264 N/A ASN 82.A ND2 GLN 103.A OE1 no hydrogen 3.089 N/A LEU 85.A N GLY 81.A O no hydrogen 3.074 N/A LEU 85.A N ASN 82.A O no hydrogen 3.068 N/A ALA 86.A N HIS 83.A O no hydrogen 3.439 N/A ILE 89.A N LEU 85.A O no hydrogen 3.089 N/A ARG 90.A N ALA 86.A O no hydrogen 2.955 N/A ARG 90.A NH1 LEU 115.A O no hydrogen 2.539 N/A ALA 91.A N PRO 87.A O no hydrogen 2.882 N/A ALA 92.A N LEU 88.A O no hydrogen 3.137 N/A ALA 93.A N ARG 90.A O no hydrogen 3.429 N/A ALA 94.A N CYS 70.A O no hydrogen 2.939 N/A ALA 97.A N ALA 94.A O no hydrogen 3.153 N/A LYS 98.A N ASP 71.A O no hydrogen 2.739 N/A VAL 99.A N HIS 121.A O no hydrogen 2.636 N/A LEU 100.A N LEU 73.A O no hydrogen 2.818 N/A LEU 101.A N LEU 123.A O no hydrogen 2.857 N/A LEU 102.A N VAL 75.A O no hydrogen 2.928 N/A GLN 103.A NE2 ALA 77.A O no hydrogen 2.920 N/A GLN 103.A NE2 ASN 82.A OD1 no hydrogen 2.879 N/A LEU 106.A N ALA 277.A O no hydrogen 2.987 N/A ARG 111.A N GLY 107.A O no hydrogen 3.141 N/A ARG 111.A NH1 LEU 106.A O no hydrogen 3.139 N/A ARG 111.A NH2 LEU 106.A O no hydrogen 2.784 N/A LEU 112.A N VAL 108.A O no hydrogen 3.209 N/A LEU 112.A N GLU 109.A O no hydrogen 3.069 N/A ARG 113.A N GLU 109.A O no hydrogen 2.821 N/A ARG 113.A NE GLU 110.A OE1 no hydrogen 2.936 N/A ARG 113.A NH2 GLU 110.A OE2 no hydrogen 2.806 N/A LEU 115.A N LEU 112.A O no hydrogen 2.882 N/A LEU 116.A N ARG 113.A O no hydrogen 3.150 N/A LEU 120.A N PRO 117.A O no hydrogen 3.091 N/A HIS 121.A N ALA 97.A O no hydrogen 2.958 N/A HIS 121.A ND1 TYR 151.A OH no hydrogen 2.887 N/A LEU 122.A N SER 153.A O no hydrogen 2.705 N/A LEU 123.A N VAL 99.A O no hydrogen 2.674 N/A GLY 124.A N GLY 150.A O no hydrogen 2.855 N/A GLY 125.A N LEU 101.A O no hydrogen 2.795 N/A LEU 126.A N ASN 148.A O no hydrogen 2.760 N/A CYS 127.A SG GLY 125.A O no hydrogen 3.828 N/A PHE 128.A N GLY 146.A O no hydrogen 2.864 N/A CYS 130.A N ALA 143.A O no hydrogen 3.043 N/A HIS 132.A N GLU 140.A O no hydrogen 2.876 N/A GLY 134.A N VAL 138.A O no hydrogen 2.940 N/A VAL 138.A N GLU 135.A O no hydrogen 2.831 N/A ILE 139.A N SER 44.A O no hydrogen 2.893 N/A GLU 140.A N HIS 132.A O no hydrogen 2.797 N/A HIS 141.A N ASN 46.A O no hydrogen 2.859 N/A HIS 141.A ND1 SER 47.A OG no hydrogen 2.654 N/A HIS 141.A NE2 ALA 143.A O no hydrogen 3.045 N/A HIS 141.A NE2 TYR 144.A O no hydrogen 2.850 N/A GLN 142.A N CYS 130.A O no hydrogen 2.823 N/A GLN 142.A NE2 ASP 258.A O no hydrogen 2.839 N/A ALA 143.A N CYS 130.A O no hydrogen 3.421 N/A GLY 145.A N PHE 128.A O no hydrogen 2.969 N/A VAL 147.A N GLU 178.A O no hydrogen 3.037 N/A ASN 148.A N LEU 126.A O no hydrogen 2.995 N/A LEU 149.A N THR 180.A O no hydrogen 3.166 N/A GLY 150.A N GLY 124.A O no hydrogen 2.965 N/A TYR 151.A OH HIS 121.A ND1 no hydrogen 2.887 N/A HIS 152.A N LEU 122.A O no hydrogen 2.916 N/A HIS 152.A NE2 GLU 110.A OE1 no hydrogen 2.906 N/A SER 153.A N LEU 122.A O no hydrogen 3.177 N/A ARG 160.A N ASP 157.A OD1 no hydrogen 2.637 N/A ARG 160.A NH1 GLU 163.A OE1 no hydrogen 2.895 N/A ARG 161.A N ASP 157.A O no hydrogen 2.767 N/A ARG 161.A NE ALA 156.A O no hydrogen 2.967 N/A ARG 162.A N GLU 158.A O no hydrogen 3.263 N/A GLU 163.A N ARG 159.A O no hydrogen 3.098 N/A ILE 164.A N ARG 160.A O no hydrogen 2.880 N/A VAL 165.A N ARG 161.A O no hydrogen 3.013 N/A GLU 166.A N ARG 162.A O no hydrogen 2.891 N/A GLU 167.A N GLU 163.A O no hydrogen 2.799 N/A GLY 168.A N ILE 164.A O no hydrogen 3.023 N/A ALA 169.A N VAL 165.A O no hydrogen 2.949 N/A ALA 170.A N GLU 166.A O no hydrogen 2.908 N/A LEU 171.A N GLU 167.A O no hydrogen 3.184 N/A PHE 172.A N GLY 168.A O no hydrogen 3.394 N/A ARG 173.A N ALA 169.A O no hydrogen 2.862 N/A ARG 173.A NH1 SER 179.A O no hydrogen 2.737 N/A ARG 173.A NH2 GLU 166.A OE1 no hydrogen 2.939 N/A GLU 174.A N ALA 170.A O no hydrogen 2.668 N/A SER 175.A N PHE 172.A O no hydrogen 2.873 N/A SER 175.A OG MET 19.A O no hydrogen 3.340 N/A SER 175.A OG LEU 171.A O no hydrogen 3.278 N/A GLY 176.A N ARG 173.A O no hydrogen 3.177 N/A LEU 177.A N PHE 172.A O no hydrogen 3.096 N/A SER 179.A OG VAL 147.A O no hydrogen 2.734 N/A THR 180.A N ASN 148.A OD1 no hydrogen 3.054 N/A THR 180.A OG1 ASN 148.A OD1 no hydrogen 3.079 N/A MET 182.A N LEU 149.A O no hydrogen 2.725 N/A GLN 187.A N ASP 184.A OD1 no hydrogen 2.872 N/A GLN 187.A NE2 GLN 191.A OE1 no hydrogen 3.105 N/A ALA 188.A N ASP 184.A O no hydrogen 3.038 N/A ARG 189.A N LEU 185.A O no hydrogen 2.880 N/A ARG 189.A NE GLU 109.A OE1 no hydrogen 3.030 N/A ARG 189.A NE GLU 109.A OE2 no hydrogen 3.176 N/A ARG 189.A NH1 GLN 103.A O no hydrogen 2.780 N/A ARG 189.A NH1 GLY 105.A O no hydrogen 3.095 N/A ARG 189.A NH2 GLN 103.A O no hydrogen 3.063 N/A ARG 189.A NH2 GLU 109.A OE2 no hydrogen 2.616 N/A TRP 190.A N GLU 186.A O no hydrogen 3.042 N/A GLN 191.A N GLN 187.A O no hydrogen 3.217 N/A LYS 192.A N ALA 188.A O no hydrogen 3.021 N/A LYS 192.A NZ ASN 104.A OD1 no hydrogen 3.160 N/A LYS 192.A NZ CYS 127.A O no hydrogen 3.308 N/A LYS 192.A NZ ASN 196.A OD1 no hydrogen 2.889 N/A LEU 193.A N ARG 189.A O no hydrogen 2.985 N/A VAL 194.A N GLN 191.A O no hydrogen 3.110 N/A TRP 195.A N LYS 192.A O no hydrogen 3.167 N/A TRP 195.A NE1 THR 253.A OG1 no hydrogen 3.049 N/A ASN 196.A N LYS 192.A O no hydrogen 3.119 N/A ASN 196.A ND2 ASN 200.A OD1 no hydrogen 2.794 N/A ILE 197.A N LEU 193.A O no hydrogen 2.899 N/A TYR 199.A N TRP 195.A O no hydrogen 3.146 N/A ASN 200.A N ASN 196.A O no hydrogen 3.118 N/A ASN 200.A ND2 SER 262.A OG no hydrogen 3.290 N/A LEU 202.A N PRO 198.A O no hydrogen 2.930 N/A SER 203.A N TYR 199.A O no hydrogen 2.995 N/A SER 203.A OG TYR 199.A O no hydrogen 3.265 N/A SER 203.A OG ASN 200.A O no hydrogen 2.849 N/A LEU 205.A N GLY 201.A O no hydrogen 2.946 N/A LEU 206.A N LEU 202.A O no hydrogen 2.743 N/A LYS 207.A N VAL 204.A O no hydrogen 3.141 N/A SER 208.A N SER 203.A O no hydrogen 3.089 N/A SER 208.A OG LEU 206.A O no hydrogen 3.204 N/A SER 209.A OG ASP 258.A OD1 no hydrogen 2.508 N/A SER 209.A OG ASP 258.A OD2 no hydrogen 3.142 N/A THR 210.A N TYR 259.A O no hydrogen 2.963 N/A THR 210.A OG1 PRO 257.A O no hydrogen 3.272 N/A ALA 211.A N ASP 258.A OD1 no hydrogen 3.037 N/A LEU 213.A N SER 209.A O no hydrogen 3.513 N/A MET 214.A N THR 210.A O no hydrogen 2.959 N/A ALA 215.A N ALA 211.A O no hydrogen 2.770 N/A ASN 216.A N PRO 212.A O no hydrogen 3.149 N/A ASP 218.A N ASN 216.A OD1 no hydrogen 2.737 N/A SER 219.A N ASN 216.A OD1 no hydrogen 3.019 N/A SER 219.A OG LEU 213.A O no hydrogen 2.669 N/A SER 219.A OG ASN 216.A O no hydrogen 3.190 N/A ARG 220.A N ASN 216.A O no hydrogen 3.038 N/A ARG 220.A NH1 GLU 254.A OE1 no hydrogen 2.305 N/A ARG 220.A NH2 GLU 254.A OE1 no hydrogen 2.778 N/A SER 221.A N ALA 217.A O no hydrogen 2.948 N/A SER 221.A OG ALA 217.A O no hydrogen 3.062 N/A LEU 222.A N ASP 218.A O no hydrogen 2.935 N/A ILE 223.A N SER 219.A O no hydrogen 2.866 N/A GLU 224.A N ARG 220.A O no hydrogen 3.113 N/A ALA 225.A N SER 221.A O no hydrogen 3.059 N/A ILE 226.A N LEU 222.A O no hydrogen 2.968 N/A MET 227.A N ILE 223.A O no hydrogen 2.819 N/A GLU 228.A N GLU 224.A O no hydrogen 3.024 N/A GLU 229.A N ALA 225.A O no hydrogen 3.241 N/A VAL 230.A N ILE 226.A O no hydrogen 3.124 N/A ILE 231.A N MET 227.A O no hydrogen 2.851 N/A GLY 232.A N GLU 228.A O no hydrogen 2.759 N/A ALA 233.A N GLU 229.A O no hydrogen 2.838 N/A ALA 234.A N VAL 230.A O no hydrogen 2.974 N/A GLY 235.A N ILE 231.A O no hydrogen 3.148 N/A ALA 236.A N GLY 232.A O no hydrogen 3.046 N/A CYS 237.A N ALA 233.A O no hydrogen 3.080 N/A CYS 237.A N ALA 234.A O no hydrogen 3.126 N/A CYS 237.A SG ALA 233.A O no hydrogen 3.678 N/A CYS 237.A SG ARG 285.A O no hydrogen 3.379 N/A GLY 238.A N GLY 235.A O no hydrogen 2.996 N/A PHE 239.A N ALA 234.A O no hydrogen 2.834 N/A TYR 245.A N PRO 242.A O no hydrogen 3.231 N/A GLN 248.A N GLY 244.A O no hydrogen 3.212 N/A LEU 249.A N TYR 245.A O no hydrogen 2.919 N/A LEU 250.A N ALA 246.A O no hydrogen 2.868 N/A ALA 251.A N ASP 247.A O no hydrogen 3.021 N/A ALA 252.A N GLN 248.A O no hydrogen 3.140 N/A THR 253.A N LEU 249.A O no hydrogen 3.129 N/A THR 253.A OG1 LEU 249.A O no hydrogen 2.919 N/A GLU 254.A N LEU 250.A O no hydrogen 3.077 N/A GLU 254.A N ALA 251.A O no hydrogen 3.256 N/A MET 256.A N THR 253.A O no hydrogen 3.137 N/A TYR 259.A N THR 210.A OG1 no hydrogen 2.937 N/A HIS 265.A N PRO 261.A O no hydrogen 3.281 N/A ASP 266.A N SER 262.A O no hydrogen 2.958 N/A PHE 267.A N MET 263.A O no hydrogen 2.986 N/A ALA 268.A N TYR 264.A O no hydrogen 3.049 N/A HIS 269.A N HIS 265.A O no hydrogen 3.017 N/A HIS 269.A N ASP 266.A O no hydrogen 3.243 N/A HIS 269.A ND1 HIS 265.A O no hydrogen 2.993 N/A GLY 270.A N PHE 267.A O no hydrogen 3.023 N/A ARG 271.A N ASP 266.A O no hydrogen 2.827 N/A ARG 271.A NE ASP 266.A OD1 no hydrogen 2.731 N/A ARG 271.A NH2 ASP 266.A OD1 no hydrogen 3.029 N/A LEU 273.A N GLU 307.A OE1 no hydrogen 3.197 N/A LEU 275.A N LEU 273.A O no hydrogen 2.769 N/A ILE 278.A N GLU 274.A O no hydrogen 3.256 N/A TYR 279.A N LEU 275.A O no hydrogen 2.781 N/A TYR 279.A OH ILE 197.A O no hydrogen 2.574 N/A ALA 280.A N LEU 275.A O no hydrogen 2.907 N/A ALA 281.A N ALA 276.A O no hydrogen 2.924 N/A LEU 283.A N TYR 279.A O no hydrogen 3.055 N/A ALA 284.A N ALA 280.A O no hydrogen 2.993 N/A ARG 285.A N ALA 281.A O no hydrogen 2.927 N/A ARG 285.A NH1 GLU 186.A OE2 no hydrogen 2.599 N/A ARG 285.A NH2 GLU 186.A OE2 no hydrogen 2.294 N/A ALA 286.A N PRO 282.A O no hydrogen 2.799 N/A ALA 287.A N LEU 283.A O no hydrogen 2.933 N/A ALA 288.A N ALA 284.A O no hydrogen 2.878 N/A ALA 289.A N ARG 285.A O no hydrogen 3.140 N/A ALA 289.A N ALA 286.A O no hydrogen 3.089 N/A GLY 290.A N ALA 287.A O no hydrogen 2.980 N/A TYR 291.A N ALA 286.A O no hydrogen 2.839 N/A ARG 292.A NH2 GLU 297.A OE1 no hydrogen 2.796 N/A ARG 295.A N GLU 229.A OE2 no hydrogen 2.856 N/A ARG 295.A NH1 GLU 229.A OE2 no hydrogen 3.038 N/A VAL 296.A N GLU 229.A OE1 no hydrogen 2.942 N/A GLU 297.A N MET 293.A O no hydrogen 2.754 N/A ALA 298.A N PRO 294.A O no hydrogen 2.782 N/A LEU 299.A N ARG 295.A O no hydrogen 2.918 N/A HIS 300.A N VAL 296.A O no hydrogen 2.953 N/A GLN 301.A N GLU 297.A O no hydrogen 3.137 N/A ALA 302.A N ALA 298.A O no hydrogen 3.009 N/A LEU 303.A N LEU 299.A O no hydrogen 2.870 N/A ARG 304.A N HIS 300.A O no hydrogen 2.830 N/A PHE 305.A N GLN 301.A O no hydrogen 2.841 N/A LEU 306.A N ALA 302.A O no hydrogen 2.910 N/A GLU 307.A N LEU 303.A O no hydrogen 2.995 N/A ALA 308.A N ARG 304.A O no hydrogen 3.167 N/A GLN 309.A N LEU 306.A O no hydrogen 3.225 N/A